methyl 2-azanyl-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate

Systemtic Name: methyl 2-azanyl-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Openeye Name: methyl 2-amino-4,5-dihydrobenzo[e]benzothiophene-1-carboxylate CAS Name: 2-amino-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate Traditional Name: 2-amino-4,5-dihydrobenzo[e]benzothiophene-1-carboxylic acid methyl ester Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)N

Isomeric SMILES

COC(=O)C1=C(SC2=C1C3=CC=CC=C3CC2)N

InChI

InChI=1S/C14H13NO2S/c1-17-14(16)12-11-9-5-3-2-4-8(9)6-7-10(11)18-13(12)15/h2-5H,6-7,15H2,1H3